(2-acetamido-1,3-benzothiazol-6-yl) thiocyanate

Systemtic Name: (2-acetamido-1,3-benzothiazol-6-yl) thiocyanate Openeye Name: (2-acetamido-1,3-benzothiazol-6-yl) thiocyanate CAS Name: thiocyanic acid (2-acetamido-1,3-benzothiazol-6-yl) ester IUPAC Name: (2-acetamido-1,3-benzothiazol-6-yl) thiocyanate Traditional Name: thiocyanic acid (2-acetamido-1,3-benzothiazol-6-yl) ester Formula: C10H7N3OS2 MolecularWeight: 249.31208

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NC2=C(S1)C=C(C=C2)SC#N

Isomeric SMILES

CC(=O)NC1=NC2=C(S1)C=C(C=C2)SC#N

InChI

InChI=1S/C10H7N3OS2/c1-6(14)12-10-13-8-3-2-7(15-5-11)4-9(8)16-10/h2-4H,1H3,(H,12,13,14)